2-(3-cyano-7,8-dimethyl-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-7,8-dimethyl-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[(3-cyano-7,8-dimethyl-2-quinolyl)sulfanyl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[(3-cyano-7,8-dimethyl-2-quinolinyl)thio]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-7,8-dimethylquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(3-cyano-7,8-dimethyl-2-quinolyl)thio]-N-(4-pyrrolidinophenyl)acetamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)N4CCCC4)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)N4CCCC4)C#N)C

InChI

InChI=1S/C24H24N4OS/c1-16-5-6-18-13-19(14-25)24(27-23(18)17(16)2)30-15-22(29)26-20-7-9-21(10-8-20)28-11-3-4-12-28/h5-10,13H,3-4,11-12,15H2,1-2H3,(H,26,29)